2-[3-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)piperidin-1-yl]acetamide

C17H25N5O3 — CID 46992901

IUPAC2-[3-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)piperidin-1-yl]acetamide
SMILESNC(=O)CN1CCCC(C(=O)N2CCC(Oc3ncccn3)CC2)C1
InChIInChI=1S/C17H25N5O3/c18-15(23)12-21-8-1-3-13(11-21)16(24)22-9-4-14(5-10-22)25-17-19-6-2-7-20-17/h2,6-7,13-14H,1,3-5,8-12H2,(H2,18,23)
InChIKeyUYWUYDBZZRUTGP-UHFFFAOYSA-N
MW347.42 g/mol
LogP0.04
Rot. Bonds5

About 2-[3-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)piperidin-1-yl]acetamide

2-[3-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)piperidin-1-yl]acetamide (PubChem CID 46992901) has the molecular formula C17H25N5O3 and a molecular weight of 347.42 g/mol. Its IUPAC name is 2-[3-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)piperidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[3-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)piperidin-1-yl]acetamide
PubChem CID46992901
Molecular FormulaC17H25N5O3
Molecular Weight347.42 g/mol
Exact Mass347.20
IUPAC Name2-[3-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)piperidin-1-yl]acetamide
SMILESNC(=O)CN1CCCC(C(=O)N2CCC(Oc3ncccn3)CC2)C1
InChIInChI=1S/C17H25N5O3/c18-15(23)12-21-8-1-3-13(11-21)16(24)22-9-4-14(5-10-22)25-17-19-6-2-7-20-17/h2,6-7,13-14H,1,3-5,8-12H2,(H2,18,23)
InChIKeyUYWUYDBZZRUTGP-UHFFFAOYSA-N
XLogP0.04
TPSA101.65 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)piperidin-1-yl]acetamide?
The IUPAC name of 2-[3-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)piperidin-1-yl]acetamide (CID 46992901) is 2-[3-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)piperidin-1-yl]acetamide.
What is the SMILES notation for 2-[3-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)piperidin-1-yl]acetamide?
The canonical SMILES for 2-[3-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)piperidin-1-yl]acetamide is NC(=O)CN1CCCC(C(=O)N2CCC(Oc3ncccn3)CC2)C1.
What is the InChIKey of 2-[3-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)piperidin-1-yl]acetamide?
The InChIKey is UYWUYDBZZRUTGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N5O3/c18-15(23)12-21-8-1-3-13(11-21)16(24)22-9-4-14(5-10-22)25-17-19-6-2-7-20-17/h2,6-7,13-14H,1,3-5,8-12H2,(H2,18,23).
What are the key properties of 2-[3-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)piperidin-1-yl]acetamide?
2-[3-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)piperidin-1-yl]acetamide has a molecular weight of 347.42 g/mol, XLogP of 0.04, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)piperidin-1-yl]acetamide is sourced from PubChem (CID 46992901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).